COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148648
Chemical Name: N-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2,6-dinitro-4-(trifluoromethyl)aniline
Smiles: Cc1ccc(c(c1)OCCNc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(C)C

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Molecular Weight: 427.38
Empirical Formula: C19H20F3N3O5

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 7.434
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 2

     

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